BDBM325817 US10273223, Compound A-13::US9637472, Compound A-13

SMILES: CC(C)n1ncc2c(cc(nc12)-c1cccc(c1)C(=O)NCCCN(C)C)C(=O)NCc1c(C)cc(C)[nH]c1=O

InChI Key: InChIKey=IJGNVDZIEPKTBL-UHFFFAOYSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 325817   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Histone-lysine N-methyltransferase EZH2 (Homo sapiens (Human))	BDBM325817 (US10273223, Compound A-13 | US9637472, Compound A-...) Show SMILES CC(C)n1ncc2c(cc(nc12)-c1cccc(c1)C(=O)NCCCN(C)C)C(=O)NCc1c(C)cc(C)[nH]c1=O Show InChI InChI=1S/C30H37N7O3/c1-18(2)37-27-25(17-33-37)23(29(39)32-16-24-19(3)13-20(4)34-30(24)40)15-26(35-27)21-9-7-10-22(14-21)28(38)31-11-8-12-36(5)6/h7,9-10,13-15,17-18H,8,11-12,16H2,1-6H3,(H,31,38)(H,32,39)(H,34,40)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<300	n/a	n/a	n/a	n/a	n/a	n/a
IRBM/Merck					Assay Description eneral Procedure for Wild-Type PRC2 Enzyme Assay on Oligonucleosome Substrate. The assays was performed in a buffer consisting of 20 mM bicine (pH=7....				J Med Chem 51: 2350-3 (2008) BindingDB Entry DOI: 10.7270/Q28P62V9
					More data for this Ligand-Target Pair
Histone-lysine N-methyltransferase EZH2 (Homo sapiens (Human))	BDBM325817 (US10273223, Compound A-13 | US9637472, Compound A-...) Show SMILES CC(C)n1ncc2c(cc(nc12)-c1cccc(c1)C(=O)NCCCN(C)C)C(=O)NCc1c(C)cc(C)[nH]c1=O Show InChI InChI=1S/C30H37N7O3/c1-18(2)37-27-25(17-33-37)23(29(39)32-16-24-19(3)13-20(4)34-30(24)40)15-26(35-27)21-9-7-10-22(14-21)28(38)31-11-8-12-36(5)6/h7,9-10,13-15,17-18H,8,11-12,16H2,1-6H3,(H,31,38)(H,32,39)(H,34,40)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<300	n/a	n/a	n/a	n/a	n/a	n/a
Epizyme, Inc. US Patent					Assay Description Recombinant PRC2 Enzymes. Human PRC2 enzymes were purified as 4-component enzyme complexes co-expressed in Spodoptera frugiperda (sf9) cells using a ...				US Patent US9637472 (2017) BindingDB Entry DOI: 10.7270/Q2X0693B
					More data for this Ligand-Target Pair